(3-Bromo-1,2-oxazol-5-yl)methanamine hydrochloride
Basic information
- CAS
90802-21-4- Standard SMILES
Cl.NCc1cc(Br)no1- InChIKey
DLEMWTVPLLIRRI-UHFFFAOYSA-N- Molecular formula
- C4H6BrClN2O
- Average molar mass
- 213.46 g/mol
- Monoisotopic mass
- 211.9352
Names & identifiers
- Preferred name
- (3-Bromo-1,2-oxazol-5-yl)methanamine hydrochloride
- IUPAC
- (3-bromo-1,2-oxazol-5-yl)methanamine;hydrochloride
- English name
- (3-Bromoisoxazol-5-yl)methylamine hydrochloride
- Molecular formula
- C4H6BrClN2O
- Molecular weight
- 213.46
Names & synonyms
(3-bromo-1,2-oxazol-5-yl)methanamine hydrochlorideRefChem:399941867-385-290802-21-4(3-Bromoisoxazol-5-yl)methylamine hydrochloride(3-Bromoisoxazol-5-yl)methanamine hydrochlorideMFCD08705903(3-bromo-1,2-oxazol-5-yl)methanamine;hydrochloride(3-BROMOISOXAZOL-5-YL)METHYLAMINE HCL(3-Bromo-5-isoxazolyl)methanamine HydrochlorideSCHEMBL567950(3-bromo-1,2-oxazol-5-yl)methanamine,hydrochloride
Show more names
(3-Bromoisoxazol-5-yl)methylamine, HCl(3-Bromoisoxazol-5-yl)methanamine hydrochloride - [B89393]
5-Isoxazolemethanamine, 3-bromo-, monohydrochlorideDTXSID60612067DLEMWTVPLLIRRI-UHFFFAOYSA-NSBB094839AKOS015846864GS-4518SY019915DB-001982
Database identifiers
- CAS
90802-21-4- PubChem CID
- 21292272
- DTXSID
DTXSID60612067- EC Number
- 867-385-2
Properties
Computed structural properties
- Topological polar surface area
- 52.1 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 9
- Formal charge
- 0
- Complexity
- 80.4
Physicochemical properties
- storage temp.
- 2 · under inert gas (nitrogen or Argon) at 2-8°C
- Appearance
- Light yellow to brown Solid
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 261 · P261-P305+P351+P338
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
Warning
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesAcute Tox. 4 (100%)
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P261-P305+P351+P338
Related reactions
4 records
Compound notes
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